3-Nitro-1H-indole - CAS 4770-03-0

Catalog:	BB026364
Product Name:	3-Nitro-1H-indole
CAS:	4770-03-0
Synonyms:	3-nitro-1H-indole; 3-nitro-1H-indole

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	3-nitro-1H-indole
Description:	3-Nitro-1H-indole (CAS# 4770-03-0) is a useful research chemical.
Molecular Weight:	162.15
Molecular Formula:	C8H6N2O2
Canonical SMILES:	C1=CC=C2C(=C1)C(=CN2)[N+](=O)[O-]
InChI:	InChI=1S/C8H6N2O2/c11-10(12)8-5-9-7-4-2-1-3-6(7)8/h1-5,9H
InChI Key:	LSMXNZJFLGIPMS-UHFFFAOYSA-N
LogP:	2.59930

Publication Number	Title	Priority Date
CN-113461590-A	Method for constructing 1-substituted cyclopropane compound by virtue of phosphine-catalyzed C-H activated amination reaction of cyclopropane	20210615
US-2021301329-A1	Single Cell Genetic Analysis	20200324
WO-2021194699-A1	Single cell genetic analysis	20200324
US-2021285044-A1	Systems and methods for nucleic acid processing using degenerate nucleotides	20200313
WO-2021173721-A1	Selective androgen receptor degrader (sard) ligands and methods of use thereof	20200225

PMID	Publication Date	Title	Journal
17880093	20071011	Multicomponent domino [4+2]/[3+2] cycloadditions of nitroheteroaromatics: an efficient synthesis of fused nitrogenated polycycles	Organic letters
16170793	20051101	Catalytic enantioselective addition of indoles to arylnitroalkenes: an effective route to enantiomerically enriched tryptamine precursors	Chirality

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Related Functional Groups

Indoles

[2642-37-7]
Indoxyl sulfate potassium salt
[1375064-59-7]
Ethyl 3-Bromoindole-1-carboxylate
[61149-52-8]
Ethyl 4-methyl-7-nitro-1H-indole-2-carboxylate
[32996-16-0]
Ethyl indole-5-carboxylate
[1670-87-7]
Indole-5-carboxamide
[1670-81-1]
Indole-5-carboxylic acid

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Complexity:	190
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	162.042927438
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	162.042927438
Rotatable Bond Count:	0
Topological Polar Surface Area:	61.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4